2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide

C14H11N5OS2 — CID 7207400

IUPAC2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1ccc(-c2ccccn2)nn1)Nc1nccs1
InChIInChI=1S/C14H11N5OS2/c20-12(17-14-16-7-8-21-14)9-22-13-5-4-11(18-19-13)10-3-1-2-6-15-10/h1-8H,9H2,(H,16,17,20)
InChIKeyDQCHCJVCLHZPCD-UHFFFAOYSA-N
MW329.41 g/mol
LogP2.73
Rot. Bonds5

About 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide

2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 7207400) has the molecular formula C14H11N5OS2 and a molecular weight of 329.41 g/mol. Its IUPAC name is 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
PubChem CID7207400
Molecular FormulaC14H11N5OS2
Molecular Weight329.41 g/mol
Exact Mass329.04
IUPAC Name2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1ccc(-c2ccccn2)nn1)Nc1nccs1
InChIInChI=1S/C14H11N5OS2/c20-12(17-14-16-7-8-21-14)9-22-13-5-4-11(18-19-13)10-3-1-2-6-15-10/h1-8H,9H2,(H,16,17,20)
InChIKeyDQCHCJVCLHZPCD-UHFFFAOYSA-N
XLogP2.73
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-((6-methylpyridin-2-yl)amino)thiazol-4-yl)-N-(5-methylthiazol-2-yl)acetamide
CID 49677967
N-(5-pyridin-3-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 46872297
2-Amino-5-thio-substituted thiazole 61
CID 5329697
1-Phenyl-3-(4-pyridin-2-yl-thiazol-2-yl)-urea
CID 10590030
3-methylsulfanyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)propanamide
CID 2594420
5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 4782304
1-(2,4-Difluorophenyl)-3-[4-(2-pyridinyl)-2-thiazolyl]urea
CID 4799115
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetamide
CID 7207414
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetamide
CID 7207416
N-[4'-methyl-2-(2-pyridinylamino)-4,5'-bi-1,3-thiazol-2'-yl]propanamide
CID 755435
N-(pyridin-2-yl)-4-(pyridin-2-yl)thiazol-2-amine
CID 772885
6-methyl-N-[4-(2-pyridinyl)-1,3-thiazol-2-yl]-2-pyridinamine
CID 972317

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide (CID 7207400) is 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide is O=C(CSc1ccc(-c2ccccn2)nn1)Nc1nccs1.
What is the InChIKey of 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is DQCHCJVCLHZPCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5OS2/c20-12(17-14-16-7-8-21-14)9-22-13-5-4-11(18-19-13)10-3-1-2-6-15-10/h1-8H,9H2,(H,16,17,20).
What are the key properties of 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 329.41 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 7207400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).